ethyl 5-(3-{[3-(azepan-1-yl)propyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-{[3-(azepan-1-yl)propyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-(3-{[3-(azepan-1-yl)propyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F602-0941 |
| Compound Name: | ethyl 5-(3-{[3-(azepan-1-yl)propyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C25 H40 N4 O4 |
| Smiles: | CCOC(c1c(C)c(C(N2CCCC(C2)C(NCCCN2CCCCCC2)=O)=O)[nH]c1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3587 |
| logD: | -0.2699 |
| logSw: | -2.4289 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.124 |
| InChI Key: | SCUBPRVHUFERKU-FQEVSTJZSA-N |